CHEBI:185692 - PI(17:1(9Z)/0:0)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name PI(17:1(9Z)/0:0)
ChEBI ID CHEBI:185692
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C26H49O12P
Net Charge 0
Average Mass 584.640
Monoisotopic Mass 584.29616
InChI InChI=1S/C26H49O12P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20(28)36-17-19(27)18-37-39(34,35)38-26-24(32)22(30)21(29)23(31)25(26)33/h8-9,19,21-27,29-33H,2-7,10-18H2,1H3,(H,34,35)/b9-8-/t19-,21?,22-,23?,24?,25?,26?/m1/s1
InChIKey WVYBCWJZPKDINL-RVUDTPQMSA-N
SMILES P(OC1C(O)C(O)C(O)[C@@H](O)C1O)(OC[C@H](O)COC(=O)CCCCCCC/C=C\CCCCCCC)(O)=O
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] See: MetaboLights Study
ChEBI Ontology
Outgoing PI(17:1(9Z)/0:0) (CHEBI:185692) is a 1-acylglycerophosphoinositol (CHEBI:16617)
IUPAC Name
[(2R)-2-hydroxy-3-[hydroxy-[(5R)-2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxypropyl] (Z)-heptadec-9-enoate
Manual Xref Database
LMGP06050032 LIPID MAPS
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